@misc{https://doi.org/10.4121/19738834.v1, doi = {10.4121/19738834.v1}, url = {https://data.4tu.nl/articles/dataset/Sample_simulation_files_for_New_Features_of_the_Open_Source_Monte_Carlo_Software_Brick-CFCMC_Thermodynamic_Integration_and_Hybrid_Trial_Moves_/19738834/1}, author = {Polat, Mert and Vlugt, Thijs and Moultos, Othonas A. and Seyed Salehi, Hirad and Hens, Remco and Rahbari, Ahmadreza and Wasik, Dominika O. and de Meyer, Frederick and Houriez, Celine and Coquelet, Christophe}, keywords = {Thermodynamics, Monte Carlo simulations, Molecular simulations, Computational chemistry, Continuous Fractional Component Monte Carlo (CFCMC)}, title = {Sample simulation files for 'New Features of the Open Source Monte Carlo Software Brick-CFCMC: Thermodynamic Integration and Hybrid Trial Moves'}, publisher = {4TU.ResearchData}, year = {2022}, copyright = {CC0}, }